2-[3-fluoranyl-4-(trifluoromethyl)phenyl]-5-hex-1-ynyl-pyrimidine

Systemtic Name: 2-[3-fluoranyl-4-(trifluoromethyl)phenyl]-5-hex-1-ynyl-pyrimidine Openeye Name: 2-[3-fluoro-4-(trifluoromethyl)phenyl]-5-hex-1-ynyl-pyrimidine CAS Name: 2-[3-fluoro-4-(trifluoromethyl)phenyl]-5-hex-1-ynylpyrimidine IUPAC Name: 2-[3-fluoro-4-(trifluoromethyl)phenyl]-5-hex-1-ynylpyrimidine Traditional Name: 2-[3-fluoro-4-(trifluoromethyl)phenyl]-5-hex-1-ynyl-pyrimidine Formula: C17H14F4N2 MolecularWeight: 322.300073

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CN=C(N=C1)C2=CC(=C(C=C2)C(F)(F)F)F

Isomeric SMILES

CCCCC#CC1=CN=C(N=C1)C2=CC(=C(C=C2)C(F)(F)F)F

InChI

InChI=1S/C17H14F4N2/c1-2-3-4-5-6-12-10-22-16(23-11-12)13-7-8-14(15(18)9-13)17(19,20)21/h7-11H,2-4H2,1H3